CAS Registry Number: 77029-01-7

Name:

1-​Naphthalenecarbonitr​ile, 6-​methoxy-
1-​Naphthonitrile, 6-​methoxy- (4CI); 5-​Cyano-​2-​methoxynaphthalene; 6-​Methoxy-​1-​cyanonaphthalene; 6-​Methoxy-​1-​naphthalenecarbonitr​ile 

Chemical Formula: C12H9NO
Exact Mass: 183.07
Molecular Weight: 183.21
m/z: 183.07 (100.0%), 184.07 (13.5%)
Elemental Analysis: C, 78.67; H, 4.95; N, 7.65; O, 8.73

InChI: InChI=1S/C12H9NO/c1-14-11-5-6-12-9(7-11)3-2-4-10(12)8-13/h2-7H,1H3
InChIKey: PGQFNNJLLVRLLW-UHFFFAOYSA-N
Canonical SMILES : COC1=CC2=CC=CC(=C2C=C1)C#N

Specification

98%

1. (1) Amin, Shantu; Journal of Organic Chemistry 1981, V46(11), P2394-8 CAPLUS
2. (2) Lemaire, Marc; Chemistry Letters 1988, (10), P1581-4 CAPLUS
3. (3) Butenandt, Adolf; Berichte der Deutschen Chemischen Gesellschaft [Abteilung] B: Abhandlungen 1935, V68B, P2083-6 CAPLUS
4. (4) Long, Louis, Jr.; Journal of Organic Chemistry 1941, V6, P852-7 CAPLUS